SCHEMBL9506422

SCHEMBL9506422

N=C(S)NS(=O)(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.54
MMP2 P08253 2/20 0.54
CA1 P00915 1/20 0.54
MMP1 P03956 1/20 0.54
MMP9 P14780 1/20 0.54
MMP8 P22894 1/20 0.54
MMP13 P45452 1/20 0.54
PTGS2 P35354 4/20 0.49
KDM4E B2RXH2 3/20 0.49
PTGS1 P23219 2/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HPGD P15428 1/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
IL1RN P18510 1/20 0.47
KEAP1 Q14145 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47
BCAT1 P54687 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ether SCHEMBL11798801 0.87 KDM4E (0.49) CA2MMP2CA1MMP1MMP9
SCHEMBL10817093 0.81 CA2 (0.56) CA2MMP2CA1MMP1MMP9
Sulfathiourea SCHEMBL27666346 0.80 TSHR (0.59) CA2MMP2CA1MMP1MMP9
SCHEMBL10967386 0.79 CA2 (0.59) CA2MMP2CA1MMP1MMP9
SCHEMBL1269819 0.79 CA2 (0.54) CA2MMP2CA1MMP1MMP9
SCHEMBL9503197 0.78 CA2 (0.57) CA2MMP2CA1MMP1MMP9
SCHEMBL2172235 0.77 CA2 (0.61) CA2MMP2CA1MMP1MMP9
SCHEMBL453442 0.76 CA2 (0.60) CA2MMP2CA1MMP1MMP9
SCHEMBL6012074 0.76 CA2 (0.60) CA2MMP2CA1MMP1MMP9
SCHEMBL10931933 0.76 CA2 (0.60) CA2MMP2CA1MMP1MMP9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5001024-A None JP disclosed
JP-60067469-A None JP disclosed
JP-60006654-A None JP disclosed
JP-H051024-A SULFONAMIDE DERIVATIVE TOSOH CORP 1993-01-08 JP disclosed
JP-S6067469-A PRODUCTION OF SUBSTITUTED PHENYLSULFONYLUREA DERIVATIVE NIPPON TOKUSHU NOYAKU SEIZO KK 1985-04-17 JP disclosed
JP-S606654-A SUBSTITUTED PHENYLSULFONYLGUANIDINE DERIVATIVE, ITS INTERMEDIATE, THEIR PREPARATION AND HERBICIDE NIPPON TOKUSHU NOYAKU SEIZO KK 1985-01-14 JP disclosed